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Compound Detail

CHEMBL565924

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CO/N=C(\Nc1cccc(Cl)c1)c1nonc1N
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL565924
Phase Preclinical
Structure Type MOL
InChI Key JDIGPJJZXXFBNK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

267.7
MW (Da)
1.73
ALogP
6
HBA
2
HBD
98.6
PSA (Ų)
0.50
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H10ClN5O2
MW 267.68
Aromatic Rings 2
Heavy Atoms 18
NP-Likeness -1.89

Literature References

PubMed DOI Target Context # Activities
19507862 10.1021/jm900518f Indoleamine 2,3-dioxygenase 1 2

Data from ChEMBL 36 via Core Engine